6-(3-methoxyphenyl)-N-methylquinazolin-4-amine

C16H15N3O — CID 3232619

IUPAC6-(3-methoxyphenyl)-N-methylquinazolin-4-amine
SMILESCNc1ncnc2ccc(-c3cccc(OC)c3)cc12
InChIInChI=1S/C16H15N3O/c1-17-16-14-9-12(6-7-15(14)18-10-19-16)11-4-3-5-13(8-11)20-2/h3-10H,1-2H3,(H,17,18,19)
InChIKeyCIAURIQGNQVISQ-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.35
Rot. Bonds3

About 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine

6-(3-methoxyphenyl)-N-methylquinazolin-4-amine (PubChem CID 3232619) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine.

Molecular Properties

Compound Name6-(3-methoxyphenyl)-N-methylquinazolin-4-amine
PubChem CID3232619
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name6-(3-methoxyphenyl)-N-methylquinazolin-4-amine
SMILESCNc1ncnc2ccc(-c3cccc(OC)c3)cc12
InChIInChI=1S/C16H15N3O/c1-17-16-14-9-12(6-7-15(14)18-10-19-16)11-4-3-5-13(8-11)20-2/h3-10H,1-2H3,(H,17,18,19)
InChIKeyCIAURIQGNQVISQ-UHFFFAOYSA-N
XLogP3.35
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine?
The IUPAC name of 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine (CID 3232619) is 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine.
What is the SMILES notation for 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine?
The canonical SMILES for 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine is CNc1ncnc2ccc(-c3cccc(OC)c3)cc12.
What is the InChIKey of 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine?
The InChIKey is CIAURIQGNQVISQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-17-16-14-9-12(6-7-15(14)18-10-19-16)11-4-3-5-13(8-11)20-2/h3-10H,1-2H3,(H,17,18,19).
What are the key properties of 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine?
6-(3-methoxyphenyl)-N-methylquinazolin-4-amine has a molecular weight of 265.32 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenyl)-N-methylquinazolin-4-amine is sourced from PubChem (CID 3232619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).